SCHEMBL13541453

SCHEMBL13541453

CC(=O)CN(CCCCN(CC(C)=O)CC(=O)O)CC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.59
▸ EYA2 O00167 1/20 0.59
▸ APP P05067 1/20 0.59
▸ ACE P12821 1/20 0.59
▸ BLM P54132 2/20 0.56
▸ PMP22 Q01453 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ DRD3 P35462 2/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ TSHR P16473 2/20 0.56
▸ CYP2C19 P33261 2/20 0.56
▸ CHRM2 P08172 1/20 0.56
▸ ADRA2A P08913 1/20 0.56
▸ DRD1 P21728 1/20 0.56
▸ SLC6A2 P23975 1/20 0.56
▸ SLC6A4 P31645 1/20 0.56
▸ ADRA1A P35348 1/20 0.56
▸ SLC6A3 Q01959 1/20 0.56
▸ HRH3 Q9Y5N1 1/20 0.56

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13010899 0.90 TDP1 (0.74) TDP1EYA2APPACEBLM
SCHEMBL13322095 0.90 TDP1 (0.74) TDP1EYA2APPACEBLM
SCHEMBL16520406 0.90 TDP1 (0.48) TDP1EYA2APPACEBLM
SCHEMBL6124947 0.88 TDP1 (0.75) TDP1EYA2APPACEBLM
SCHEMBL13201916 0.88 TDP1 (0.75) TDP1EYA2APPACEBLM
SCHEMBL12517909 0.88 TDP1 (0.75) TDP1EYA2APPACEBLM
SCHEMBL10005587 0.88 TDP1 (0.75) TDP1EYA2APPACEBLM
SCHEMBL13398968 0.88 TDP1 (0.75) TDP1EYA2APPACEBLM
SCHEMBL3904822 0.88 TDP1 (0.75) TDP1EYA2APPACEBLM
SCHEMBL16406527 0.88 TDP1 (0.75) TDP1EYA2APPACEBLM

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004390-A1 BIODEGRADABLE METAL-CHELATING POLYMERS AND VACCINES MEDIVAS, LLC (US) 2010-01-07 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100004390-A1 BIODEGRADABLE METAL-CHELATING POLYMERS AND VACCINES HLA-A, HLA-C, EEA1 TDP1 4497/4885EYA2 4498/4885APP 536/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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